6-chloro-7-methyl-4-{[4-(3-phenylprop-2-en-1-yl)piperazin-1-yl]methyl}-2H-1-benzopyran-2-one
Chemical Structure Depiction of
6-chloro-7-methyl-4-{[4-(3-phenylprop-2-en-1-yl)piperazin-1-yl]methyl}-2H-1-benzopyran-2-one
6-chloro-7-methyl-4-{[4-(3-phenylprop-2-en-1-yl)piperazin-1-yl]methyl}-2H-1-benzopyran-2-one
Compound characteristics
| Compound ID: | Y041-3922 |
| Compound Name: | 6-chloro-7-methyl-4-{[4-(3-phenylprop-2-en-1-yl)piperazin-1-yl]methyl}-2H-1-benzopyran-2-one |
| Molecular Weight: | 408.93 |
| Molecular Formula: | C24 H25 Cl N2 O2 |
| Smiles: | Cc1cc2c(cc1[Cl])C(CN1CCN(CC1)C/C=C/c1ccccc1)=CC(=O)O2 |
| Stereo: | ACHIRAL |
| logP: | 5.0255 |
| logD: | 4.9662 |
| logSw: | -5.1653 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 27.8971 |
| InChI Key: | KNUVHGRQBBVDFI-UHFFFAOYSA-N |